Structure

Basic information

Pretty formulaBH4NF4
Full formulaB4H16N4F16
TagsAmmonium tetrafluoroborate - IV;
Ammonium tetrafluoroborate - III;
Barberiite;
Barberiite low;
Ammonium
Constituent elementsB; F; H; N;
Number of elements4
Number of sites40
Volume374.20043 Å3
Density1.86099 g/cm3
Source Materials Project

Space group

Spacegroup Number62
Hermann MauguinPnma
Hall-P 2ac 2n
Crystal SystemOrthorhombic

Lattice Parameters

a7.232 Å b8.950 Å c5.781 Å
α90.000° β90.000° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-214.90440 eV -5.37261 eV -2.04540 eV 7.47090 eV 0.00000 eV 0.00000 eV